SCHEMBL10724170

C=C[C@H](NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)OCc1ccccc1)C(=O)N[C@H](CC(C)C)O/[P+]([O-])=C/C(=O)N[C@H](CO)[C@@H](C)CC

nearest known ligand 0.49

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	CTSB	P07858	8/20	0.49

▸	CTSK	P43235	4/20	0.49

▸	REN	P00797	3/20	0.47

▸	CASP3	P42574	1/20	0.43

▸	CTSL	P07711	9/20	0.41

▸	MME	P08473	1/20	0.38

▸	ACE	P12821	1/20	0.38

▸	CPA1	P15085	1/20	0.38

▸	ACE2	Q9BYF1	1/20	0.38

▸	PSMB5	P28074	1/20	0.38

▸	TGM2	P21980	1/20	0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compound	similarity	top predicted	shared targets
SCHEMBL10725355	0.94	CTSB (0.55)	CTSBCTSKRENCASP3CTSL
SCHEMBL10720241	0.89	CTSB (0.48)	CTSBCTSKRENCASP3CTSL
SCHEMBL10725462	0.88	REN (0.49)	CTSBCTSKRENCASP3CTSL
SCHEMBL10722073	0.88	CTSB (0.47)	CTSBCTSKRENCASP3CTSL
SCHEMBL10724160	0.81	CTSB (0.49)	CTSBCTSKRENCASP3CTSL
SCHEMBL10722745	0.77	REN (0.48)	CTSBCTSKRENCASP3CTSL
SCHEMBL10724623	0.77	REN (0.49)	CTSBCTSKRENCASP3CTSL
SCHEMBL10722840	0.77	REN (0.49)	CTSBCTSKRENCASP3CTSL
SCHEMBL10720915	0.77	REN (0.49)	CTSBCTSKRENCASP3CTSL
SCHEMBL10725341	0.77	REN (0.62)	CTSBCTSKRENCASP3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-4698329-A	HYPOTENSIVE AGENTS	SANKYO COMPANY, LIMITED (JP)	1987-10-06	—	—	US	disclosed
EP-0152255-A2	New renin-inhibitory peptides and their use	SANKYO COMPANY LIMITED (JP)	1985-08-21	—	—	EP	disclosed